1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-8-methyl-chromeno[4,3-c]pyrazol-4-one

Systemtic Name: 1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-8-methyl-chromeno[4,3-c]pyrazol-4-one Openeye Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-8-methyl-chromeno[4,3-c]pyrazol-4-one CAS Name: 1-[2-(1-azepanyl)-2-oxoethyl]-8-methyl-4-[1]benzopyrano[4,3-c]pyrazolone IUPAC Name: 1-[2-(azepan-1-yl)-2-oxoethyl]-8-methylchromeno[4,3-c]pyrazol-4-one Traditional Name: 1-[2-(azepan-1-yl)-2-keto-ethyl]-8-methyl-chromeno[4,3-c]pyrazol-4-one Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=O)C3=C2N(N=C3)CC(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=O)C3=C2N(N=C3)CC(=O)N4CCCCCC4

InChI

InChI=1S/C19H21N3O3/c1-13-6-7-16-14(10-13)18-15(19(24)25-16)11-20-22(18)12-17(23)21-8-4-2-3-5-9-21/h6-7,10-11H,2-5,8-9,12H2,1H3